4-ethylsulfonyl-N-propylmorpholine-3-carboxamide

C10H20N2O4S — CID 83105676

IUPAC4-ethylsulfonyl-N-propylmorpholine-3-carboxamide
SMILESCCCNC(=O)C1COCCN1S(=O)(=O)CC
InChIInChI=1S/C10H20N2O4S/c1-3-5-11-10(13)9-8-16-7-6-12(9)17(14,15)4-2/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyAUPWPQUYJHHJHB-UHFFFAOYSA-N
MW264.35 g/mol
LogP-0.44
Rot. Bonds5

About 4-ethylsulfonyl-N-propylmorpholine-3-carboxamide

4-ethylsulfonyl-N-propylmorpholine-3-carboxamide (PubChem CID 83105676) has the molecular formula C10H20N2O4S and a molecular weight of 264.35 g/mol. Its IUPAC name is 4-ethylsulfonyl-N-propylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-ethylsulfonyl-N-propylmorpholine-3-carboxamide
PubChem CID83105676
Molecular FormulaC10H20N2O4S
Molecular Weight264.35 g/mol
Exact Mass264.11
IUPAC Name4-ethylsulfonyl-N-propylmorpholine-3-carboxamide
SMILESCCCNC(=O)C1COCCN1S(=O)(=O)CC
InChIInChI=1S/C10H20N2O4S/c1-3-5-11-10(13)9-8-16-7-6-12(9)17(14,15)4-2/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyAUPWPQUYJHHJHB-UHFFFAOYSA-N
XLogP-0.44
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-(propylcarbamoyl)morpholin-4-yl]sulfonylacetic acid
CID 83106592
4-[3-(propylcarbamoyl)morpholin-4-yl]sulfonylbutanoic acid
CID 83098790
4-(chloromethylsulfonyl)-N-ethylmorpholine-3-carboxamide
CID 83103776
3-N-propylmorpholine-3,4-dicarboxamide
CID 83106321
4-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-N-propylmorpholine-3-carboxamide
CID 83104985
4-[(5-amino-1H-pyrazol-4-yl)sulfonyl]-N-propylmorpholine-3-carboxamide
CID 83096979
4-N-butyl-3-N-propylmorpholine-3,4-dicarboxamide
CID 116657442
4-(3-oxobutan-2-yl)-N-propylmorpholine-3-carboxamide
CID 83103248
4-(3-aminopropanoyl)-N-propylmorpholine-3-carboxamide
CID 83106811
2-methyl-2-[[3-(propylcarbamoyl)morpholine-4-carbonyl]amino]propanoic acid
CID 83104560
4-[2-oxo-2-(oxolan-3-yl)ethyl]-N-propylmorpholine-3-carboxamide
CID 104751044
4-[2-(methylamino)propanoyl]-N-propylmorpholine-3-carboxamide
CID 83097059

Frequently Asked Questions

What is the IUPAC name of 4-ethylsulfonyl-N-propylmorpholine-3-carboxamide?
The IUPAC name of 4-ethylsulfonyl-N-propylmorpholine-3-carboxamide (CID 83105676) is 4-ethylsulfonyl-N-propylmorpholine-3-carboxamide.
What is the SMILES notation for 4-ethylsulfonyl-N-propylmorpholine-3-carboxamide?
The canonical SMILES for 4-ethylsulfonyl-N-propylmorpholine-3-carboxamide is CCCNC(=O)C1COCCN1S(=O)(=O)CC.
What is the InChIKey of 4-ethylsulfonyl-N-propylmorpholine-3-carboxamide?
The InChIKey is AUPWPQUYJHHJHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O4S/c1-3-5-11-10(13)9-8-16-7-6-12(9)17(14,15)4-2/h9H,3-8H2,1-2H3,(H,11,13).
What are the key properties of 4-ethylsulfonyl-N-propylmorpholine-3-carboxamide?
4-ethylsulfonyl-N-propylmorpholine-3-carboxamide has a molecular weight of 264.35 g/mol, XLogP of -0.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylsulfonyl-N-propylmorpholine-3-carboxamide is sourced from PubChem (CID 83105676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).